Herzenbergite
Schnering H G, Wiedemeier H
Zeitschrift fur Kristallographie 156 (1981) 143-150
The high temperature structure of beta-SnS and beta-SnSe
and the B16-to-B33 type gamma-transition path
Sample: T = 905 K
Locality: synthetic
_database_code_amcsd 0010837
CELL PARAMETERS: 4.1480 11.4800 4.1770 90.000 90.000 90.000
SPACE GROUP: Cmcm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 198.905
Density (g/cm3): 5.034
MAX. ABS. INTENSITY / VOLUME**2: 108.9421145
RIR: 7.046
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
22.79 42.74 3.9012 1 1 0 4
26.39 49.68 3.3774 0 2 1 4
31.16 45.12 2.8700 0 4 0 2
31.38 100.00 2.8511 1 1 1 8
31.82 7.78 2.8126 1 3 0 4
38.04 2.92 2.3654 0 4 1 4
38.59 47.64 2.3330 1 3 1 8
43.32 18.58 2.0885 0 0 2 2
43.64 18.15 2.0740 2 0 0 2
45.13 13.59 2.0088 1 5 0 4
49.50 10.01 1.8412 1 1 2 8
50.41 20.47 1.8103 1 5 1 8
51.72 14.68 1.7674 2 2 1 8
52.61 8.62 1.7395 0 6 1 4
54.33 15.84 1.6887 0 4 2 4
54.59 15.57 1.6810 2 4 0 4
54.74 3.25 1.6768 1 3 2 8
59.25 1.31 1.5595 2 4 1 8
63.18 10.35 1.4716 2 0 2 4
64.35 8.18 1.4478 1 5 2 8
64.99 3.17 1.4350 0 8 0 2
65.11 6.67 1.4326 1 7 1 8
68.33 1.66 1.3727 3 1 0 4
69.23 1.18 1.3571 0 8 1 4
69.46 2.65 1.3531 0 2 3 4
70.68 6.19 1.3328 2 6 1 8
72.02 6.65 1.3113 1 1 3 8
72.13 11.83 1.3095 2 4 2 8
72.48 6.51 1.3041 3 1 1 8
76.31 4.88 1.2478 1 3 3 8
76.76 4.79 1.2416 3 3 1 8
78.44 3.39 1.2192 1 9 0 4
81.21 1.87 1.1845 3 5 0 4
81.36 2.99 1.1827 0 8 2 4
81.58 2.97 1.1801 2 8 0 4
82.40 2.52 1.1704 1 9 1 8
84.45 1.65 1.1471 3 1 2 8
84.70 3.59 1.1443 1 5 3 8
85.14 3.54 1.1395 3 5 1 8
85.51 1.22 1.1356 2 8 1 8
85.73 2.67 1.1332 2 2 3 8
86.44 1.63 1.1258 0 6 3 4
88.28 2.07 1.1070 0 10 1 4
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.